Geometry & MOs

Info

ID:	328785
PubChem CID:	126727766
Reduced:	ON4C30H42 (1)
Stoich.:	AB4C30D42 (1)
Weight, g/mol:	319.23
ΔH_f, kcal/mol:	-9.35
Dipole, Da:	5.82
IP(EA), eV:	-8.26(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4,5-dimethyl-2-[(5Z)-4-methyl-5-(2-methylprop-1-enyl)octa-1,5-dien-7-yn-2-yl]phenyl]ethanimine

Drug info:

PubChemData

Smile

CCCCN(CCC)C[C@@H](CCC1=CC2=C(C=C1C)N=CN=C2CC3=CC(=CC=C3)NC(=C)C)O

DOS

IR

Vibrations